dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane

C35H29P — CID 158473253

IUPACdimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane
SMILESC=P(C)(C)c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccccc4)cc3)c3ccccc23)cc1
InChIInChI=1S/C35H29P/c1-36(2,3)29-23-21-28(22-24-29)35-32-15-9-7-13-30(32)34(31-14-8-10-16-33(31)35)27-19-17-26(18-20-27)25-11-5-4-6-12-25/h4-24H,1H2,2-3H3
InChIKeyWMQCECYJHNBNJC-UHFFFAOYSA-N
MW480.59 g/mol
LogP9.33
Rot. Bonds4

About dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane

dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane (PubChem CID 158473253) has the molecular formula C35H29P and a molecular weight of 480.59 g/mol. Its IUPAC name is dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane.

Molecular Properties

Compound Namedimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane
PubChem CID158473253
Molecular FormulaC35H29P
Molecular Weight480.59 g/mol
Exact Mass480.20
IUPAC Namedimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane
SMILESC=P(C)(C)c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccccc4)cc3)c3ccccc23)cc1
InChIInChI=1S/C35H29P/c1-36(2,3)29-23-21-28(22-24-29)35-32-15-9-7-13-30(32)34(31-14-8-10-16-33(31)35)27-19-17-26(18-20-27)25-11-5-4-6-12-25/h4-24H,1H2,2-3H3
InChIKeyWMQCECYJHNBNJC-UHFFFAOYSA-N
XLogP9.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500480.59
LogP ≤ 59.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

dimethyl-methylidene-(4-phenylphenyl)-λ5-phosphane
CID 59915525
dimethyl-methylidene-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-λ5-phosphane
CID 159522397
9-phenyl-10-[4-[phenyl-(4-phenylphenyl)phosphoryl]phenyl]anthracene
CID 166031061
dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane
CID 166895339
methane;9-(4-phenylphenyl)-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene
CID 143224896
9-dimethylphosphoryl-10-(4-phenylphenyl)anthracene
CID 145317230
9-methyl-10-(4-phenylphenyl)anthracene
CID 58820618
9-(4-methylphenyl)-10-phenylanthracene
CID 631292
9,10-diphenylanthracene;ethane;prop-1-ene
CID 90840257
CID 143321579
CID 143321579
9-(3-phenylphenyl)-10-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]anthracene
CID 59557543
methyl-[10-(4-phenylphenyl)anthracen-9-yl]phosphane
CID 129174523

Frequently Asked Questions

What is the IUPAC name of dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane?
The IUPAC name of dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane (CID 158473253) is dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane.
What is the SMILES notation for dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane?
The canonical SMILES for dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane is C=P(C)(C)c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccccc4)cc3)c3ccccc23)cc1.
What is the InChIKey of dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane?
The InChIKey is WMQCECYJHNBNJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H29P/c1-36(2,3)29-23-21-28(22-24-29)35-32-15-9-7-13-30(32)34(31-14-8-10-16-33(31)35)27-19-17-26(18-20-27)25-11-5-4-6-12-25/h4-24H,1H2,2-3H3.
What are the key properties of dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane?
dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane has a molecular weight of 480.59 g/mol, XLogP of 9.33, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane is sourced from PubChem (CID 158473253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).